basic_info |
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Product_Name: | 吖啶盐(NSP-AS) |
CAS: | 211106-69-3 |
中文同义词: | 吖啶盐(NSP-AS) |
EnglishSynonyms: | 3-[9-(((3-(CARBOXYPROPYL)[4-METHOXYLPHENYL]SULFONYL)AMINE)CARBOXYL]-10-ACRIDINIUMYL)-1-PROPANESULFONATE INNER SALT |
pro_mdlNumber: | MFCD22200710 |
pro_acceptors: | 10 |
pro_donors: | 1 |
pro_smile: | Cc1ccc(cc1)S(=O)(=O)N(CCCC(=O)O)C(=O)c2c3ccccc3[n+](c4c2cccc4)CCCS(=O)(=O)[O-] |
InChi: | InChI=1S/C28H28N2O8S2/c1-20-13-15-21(16-14-20)40(37,38)30(18-6-12-26(31)32)28(33)27-22-8-2-4-10-24(22)29(17-7-19-39(34,35)36)25-11-5-3-9-23(25)27/h2-5,8-11,13-16H,6-7,12,17-19H2,1H3,(H-,31,32,34,35,36) |
InChiKey: | InChIKey=VYTOBATYLKBDAR-UHFFFAOYSA-N |
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